mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-11-18 19:32:20 +01:00
752 lines
28 KiB
Plaintext
752 lines
28 KiB
Plaintext
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ALUMINUM
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S 16
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G 1
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G 1
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G 1
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H 1
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H 1
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I 1
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SILICON
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S 16
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S 16
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S 16
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S 1
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S 1
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S 1
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S 1
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S 1
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P 9
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P 9
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PHOSPHORUS
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S 16
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S 16
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S 16
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3 183600.0000000 0.0000050
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7 2687.0000000 0.0006122
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S 1
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1 1.7120000 1.0000000
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S 1
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S 1
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P 9
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G 1
|
||
|
|
1 0.5055000 1.0000000
|
||
|
|
H 1
|
||
|
|
1 1.8743000 1.0000000
|
||
|
|
H 1
|
||
|
|
1 0.8871000 1.0000000
|
||
|
|
I 1
|
||
|
|
1 1.5066000 1.0000000
|
||
|
|
|
||
|
|
|